#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2tss s THR 2 N 0.00 3.02 0.76 2.46 -4.23 -1.26 -4.43 115.64 111.96 2tss s THR 2 Ca 0.00 -2.04 -0.09 0.00 -1.18 0.00 0.00 61.69 58.38 2tss s THR 2 Cb 0.00 -2.71 0.08 0.00 1.34 0.00 0.00 72.50 71.21 2tss s THR 2 CO 0.00 -0.33 1.09 0.54 -0.54 0.00 0.00 174.62 175.38 2tss s ASN 3 N -3.65 4.56 0.44 3.99 2.20 -1.26 -4.93 114.94 116.29 2tss s ASN 3 Ca 0.32 0.52 0.16 0.00 -0.94 0.00 0.00 52.86 52.92 2tss s ASN 3 Cb -0.04 -1.06 0.99 0.00 -2.00 0.00 0.00 41.25 39.14 2tss s ASN 3 CO 0.19 -1.80 1.96 0.44 -2.94 0.00 0.00 177.10 174.94 2tss h ASP 4 N -0.83 0.00 -0.40 3.54 5.19 -2.00 -2.67 116.42 119.25 2tss h ASP 4 Ca -0.45 0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 55.93 2tss h ASP 4 Cb 1.31 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.81 2tss h ASP 4 CO 0.60 0.23 0.10 -1.13 -3.12 0.00 0.00 179.24 175.91 2tss h ASN 5 N 0.00 0.60 -0.67 6.45 -1.24 -1.99 -1.99 115.58 116.74 2tss h ASN 5 Ca -0.00 -0.23 -0.04 0.00 0.71 0.00 0.00 56.30 56.73 2tss h ASN 5 Cb 0.42 -0.16 -0.03 0.00 0.73 0.00 0.00 38.32 39.28 2tss h ASN 5 CO 0.03 0.67 0.26 0.40 -1.29 0.00 0.00 177.43 177.50 2tss h ILE 6 N 0.50 1.24 -0.35 2.57 1.08 -1.85 -2.31 117.51 118.39 2tss h ILE 6 Ca 0.13 -0.79 -0.07 0.00 -0.39 0.00 0.00 64.86 63.74 2tss h ILE 6 Cb 0.31 0.43 -0.02 0.00 -3.07 0.00 0.00 36.82 34.47 2tss h ILE 6 CO 0.00 0.31 -0.07 0.11 -0.69 0.00 0.00 178.15 177.82 2tss h LYS 7 N 1.01 0.58 -0.60 2.37 1.57 -1.22 -1.50 116.57 118.78 2tss h LYS 7 Ca 0.23 -0.16 -0.09 0.00 -1.87 0.00 0.00 60.65 58.76 2tss h LYS 7 Cb 0.22 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 2tss h LYS 7 CO -0.02 0.66 0.01 -0.44 -0.57 0.00 0.00 179.45 179.09 2tss h ASP 8 N 0.55 1.03 -0.57 0.86 3.32 -0.85 -2.34 116.42 118.42 2tss h ASP 8 Ca 0.11 -0.28 -0.08 0.00 0.02 0.00 0.00 57.03 56.79 2tss h ASP 8 Cb 0.45 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 2tss h ASP 8 CO 0.02 1.07 0.04 -0.07 -1.72 0.00 0.00 179.24 178.58 2tss h LEU 9 N 0.96 0.96 -0.64 1.55 3.38 -1.02 -1.31 115.31 119.20 2tss h LEU 9 Ca 0.17 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 2tss h LEU 9 Cb 0.54 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 2tss h LEU 9 CO 0.03 1.01 0.34 0.25 0.09 0.00 0.00 178.44 180.15 2tss h LEU 10 N 0.88 0.81 -0.43 1.67 5.85 -1.16 0.66 115.31 123.59 2tss h LEU 10 Ca 0.17 -0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.74 2tss h LEU 10 Cb 0.49 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 2tss h LEU 10 CO 0.02 0.69 0.11 0.44 -0.34 0.00 0.00 178.44 179.36 2tss h ASP 11 N 0.88 0.65 0.12 1.25 3.32 -1.22 -1.02 116.42 120.39 2tss h ASP 11 Ca 0.22 -0.23 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 2tss h ASP 11 Cb 0.07 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.45 2tss h ASP 11 CO -0.03 0.71 -0.06 -0.25 -1.72 0.00 0.00 179.24 177.89 2tss h TRP 12 N 0.56 -0.14 0.00 4.55 2.91 -0.99 -3.20 115.95 119.63 2tss h TRP 12 Ca 0.14 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.15 2tss h TRP 12 Cb 0.31 0.05 0.00 0.00 -0.51 0.00 0.00 29.16 29.00 2tss h TRP 12 CO 0.02 0.16 -0.08 1.88 -1.03 0.00 0.00 178.44 179.39 2tss h TYR 13 N -0.45 0.00 0.00 2.65 0.05 -0.91 -3.27 116.97 115.04 2tss h TYR 13 Ca -0.02 0.00 -0.18 0.00 0.05 0.00 0.00 58.73 58.58 2tss h TYR 13 Cb 0.37 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.08 2tss h TYR 13 CO 0.02 0.00 -1.05 0.66 -1.05 0.00 0.00 178.16 176.74 2tss h SER 14 N 0.00 0.00 -3.99 3.88 4.64 -1.27 -3.38 113.55 113.43 2tss h SER 14 Ca 0.00 0.00 -0.46 0.00 -0.47 0.00 0.00 61.79 60.86 2tss h SER 14 Cb 0.77 0.00 0.15 0.00 -0.31 0.00 0.00 62.40 63.01 2tss h SER 14 CO 0.00 0.75 0.23 -0.94 -0.87 0.00 0.00 176.83 176.00 2tss s SER 15 N -6.33 2.93 0.36 4.97 1.04 -1.21 -5.05 113.70 110.41 2tss s SER 15 Ca 0.00 1.14 0.00 0.00 0.48 0.00 0.00 55.95 57.58 2tss s SER 15 Cb 0.09 -1.79 0.00 0.00 0.10 0.00 0.00 66.02 64.42 2tss s SER 15 CO 0.80 -2.93 0.00 0.61 0.98 0.00 0.00 173.24 172.69 2tss n GLY 16 N -1.41 -0.52 3.36 7.32 0.00 -1.26 -5.04 105.19 107.64 2tss n GLY 16 Ca 0.06 -1.71 -0.18 0.00 0.00 0.00 0.00 46.02 44.19 2tss n GLY 16 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2tss s SER 17 N -1.00 1.90 -0.11 1.61 1.04 -1.26 -4.83 113.70 111.05 2tss s SER 17 Ca 0.00 -1.27 -0.03 0.00 0.48 0.00 0.00 55.95 55.12 2tss s SER 17 Cb 0.00 0.00 -0.03 0.00 0.10 0.00 0.00 66.02 66.09 2tss s SER 17 CO 0.00 -0.55 0.01 -1.81 0.98 0.00 0.00 173.24 171.87 2tss s ASP 18 N -3.35 5.29 -0.07 7.02 1.01 0.49 -4.98 116.67 122.07 2tss s ASP 18 Ca 0.31 0.11 0.01 0.00 0.71 0.00 0.00 52.55 53.70 2tss s ASP 18 Cb 0.07 -1.63 0.02 0.00 1.01 0.00 0.00 42.92 42.38 2tss s ASP 18 CO 0.11 0.32 -0.09 -0.89 0.21 0.00 0.00 175.17 174.82 2tss s THR 19 N -0.50 0.99 -0.02 -1.27 2.01 -1.26 -1.38 115.64 114.20 2tss s THR 19 Ca 0.09 -0.35 -0.02 0.00 0.31 0.00 0.00 61.69 61.72 2tss s THR 19 Cb -0.12 -0.95 0.01 0.00 0.01 0.00 0.00 72.50 71.45 2tss s THR 19 CO 0.02 0.33 0.06 -0.36 -0.69 0.00 0.00 174.62 173.98 2tss s PHE 20 N 1.01 -0.05 0.06 4.92 0.08 -0.59 -5.00 117.98 118.40 2tss s PHE 20 Ca -0.08 0.17 0.09 0.00 0.12 0.00 0.00 56.93 57.22 2tss s PHE 20 Cb -0.15 -0.03 -0.03 0.00 -0.57 0.00 0.00 43.02 42.24 2tss s PHE 20 CO -0.00 -0.05 -0.23 0.95 -0.10 0.00 0.00 175.22 175.79 2tss s THR 21 N 0.30 2.45 -1.31 0.64 -4.23 -1.26 -0.56 115.64 111.66 2tss s THR 21 Ca -0.02 -1.36 -0.04 0.00 -1.18 0.00 0.00 61.69 59.09 2tss s THR 21 Cb -0.03 -2.01 0.00 0.00 1.34 0.00 0.00 72.50 71.80 2tss s THR 21 CO -0.01 0.31 0.47 0.59 -0.54 0.00 0.00 174.62 175.43 2tss n ASN 22 N 1.53 -5.35 -4.83 3.99 4.13 -1.11 -4.66 115.26 108.96 2tss n ASN 22 Ca -0.17 -0.22 -0.31 0.00 1.68 0.00 0.00 54.58 55.57 2tss n ASN 22 Cb 0.52 -4.21 0.04 0.00 -1.54 0.00 0.00 39.78 34.60 2tss n ASN 22 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 2tss s SER 23 N -2.71 5.50 -0.08 6.41 0.01 -0.17 -4.63 113.70 118.03 2tss s SER 23 Ca 0.23 1.51 0.02 0.00 1.31 0.00 0.00 55.95 59.02 2tss s SER 23 Cb -0.10 -2.41 -0.02 0.00 0.21 0.00 0.00 66.02 63.70 2tss s SER 23 CO 0.29 -1.35 -0.13 -0.70 0.41 0.00 0.00 173.24 171.76 2tss s GLU 24 N -5.11 2.87 -0.09 12.44 2.12 0.20 -1.20 118.70 129.93 2tss s GLU 24 Ca 0.58 -0.67 -0.30 0.00 0.36 0.00 0.00 54.97 54.93 2tss s GLU 24 Cb -0.13 -2.50 -0.02 0.00 0.26 0.00 0.00 34.13 31.73 2tss s GLU 24 CO 0.54 0.47 1.19 0.08 -0.54 0.00 0.00 175.26 177.01 2tss s VAL 25 N -0.33 4.33 -0.22 3.70 1.01 -0.44 -0.52 120.40 127.92 2tss s VAL 25 Ca 0.03 1.64 0.00 0.00 0.00 0.00 0.00 61.98 63.65 2tss s VAL 25 Cb -0.13 -4.05 -0.19 0.00 0.00 0.00 0.00 36.38 32.01 2tss s VAL 25 CO 0.02 -0.04 -0.08 0.18 0.00 0.00 0.00 175.10 175.19 2tss n LEU 26 N 5.54 2.86 -3.64 3.92 4.77 0.13 -0.67 117.00 129.91 2tss n LEU 26 Ca 0.11 -0.05 -0.16 0.00 -0.03 0.00 0.00 56.01 55.89 2tss n LEU 26 Cb 0.46 -0.95 -0.07 0.00 -2.33 0.00 0.00 43.42 40.53 2tss n LEU 26 CO 0.55 0.91 0.23 -0.62 -1.33 0.00 0.00 177.39 177.13 2tss s ASP 27 N -6.64 -0.42 -0.16 -1.43 2.15 -0.91 -4.80 116.67 104.46 2tss s ASP 27 Ca -0.32 0.39 -0.04 0.00 0.43 0.00 0.00 52.55 53.01 2tss s ASP 27 Cb 0.08 0.42 0.06 0.00 -0.30 0.00 0.00 42.92 43.18 2tss s ASP 27 CO 0.64 -0.53 0.07 0.21 -0.17 0.00 0.00 175.17 175.39 2tss s ASN 28 N -1.28 2.35 0.50 -0.34 3.84 -1.26 -1.14 114.94 117.61 2tss s ASN 28 Ca -0.12 -0.59 0.01 0.00 0.21 0.00 0.00 52.86 52.38 2tss s ASN 28 Cb -0.03 -0.33 -0.01 0.00 -0.55 0.00 0.00 41.25 40.33 2tss s ASN 28 CO 0.07 -0.32 0.03 -0.94 -2.79 0.00 0.00 177.10 173.14 2tss s SER 29 N 2.07 3.89 0.10 -4.21 1.04 -0.94 -5.03 113.70 110.62 2tss s SER 29 Ca 0.02 -1.67 -0.31 0.00 0.48 0.00 0.00 55.95 54.46 2tss s SER 29 Cb -0.16 0.56 -0.09 0.00 0.10 0.00 0.00 66.02 66.43 2tss s SER 29 CO -0.08 -0.89 1.70 -0.22 0.98 0.00 0.00 173.24 174.73 2tss s LEU 30 N -3.83 4.38 0.00 2.42 2.96 -1.26 -2.40 118.68 120.94 2tss s LEU 30 Ca 0.08 2.60 0.00 0.00 -0.22 0.00 0.00 54.13 56.59 2tss s LEU 30 Cb 0.01 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.13 2tss s LEU 30 CO 0.05 -0.92 0.00 0.61 -1.32 0.00 0.00 176.35 174.77 2tss n GLY 31 N 4.04 0.67 3.74 7.98 0.00 -1.26 -4.97 105.19 115.39 2tss n GLY 31 Ca 0.16 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.10 2tss n GLY 31 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2tss s SER 32 N -2.60 -0.22 -0.08 1.61 1.04 -1.01 0.22 113.70 112.66 2tss s SER 32 Ca 0.00 -0.66 -0.09 0.00 0.48 0.00 0.00 55.95 55.67 2tss s SER 32 Cb 0.00 0.67 0.02 0.00 0.10 0.00 0.00 66.02 66.81 2tss s SER 32 CO 0.00 -1.25 0.25 -0.04 0.98 0.00 0.00 173.24 173.18 2tss s MET 33 N -3.94 0.36 -0.21 4.02 -1.94 -0.50 -2.21 119.30 114.88 2tss s MET 33 Ca 0.14 0.22 -0.04 0.00 -1.71 0.00 0.00 55.69 54.29 2tss s MET 33 Cb -0.04 0.17 -0.02 0.00 2.01 0.00 0.00 34.83 36.95 2tss s MET 33 CO 0.06 -0.06 -0.02 0.50 -0.01 0.00 0.00 175.02 175.49 2tss s ARG 34 N -0.19 3.48 -0.01 2.03 3.52 -0.30 -1.50 118.95 125.99 2tss s ARG 34 Ca -0.03 -0.58 0.05 0.00 -0.13 0.00 0.00 55.73 55.04 2tss s ARG 34 Cb -0.03 -3.05 -0.01 0.00 -1.56 0.00 0.00 34.95 30.30 2tss s ARG 34 CO 0.01 -0.12 -0.17 0.42 -0.81 0.00 0.00 175.30 174.63 2tss s ILE 35 N 1.30 1.33 -0.23 4.11 1.01 -0.10 -0.69 121.20 127.93 2tss s ILE 35 Ca 0.04 -0.76 -0.08 0.00 0.00 0.00 0.00 60.65 59.86 2tss s ILE 35 Cb -0.14 -1.11 -0.04 0.00 0.01 0.00 0.00 42.46 41.18 2tss s ILE 35 CO -0.00 0.35 0.08 -0.75 0.00 0.00 0.00 174.94 174.61 2tss s LYS 36 N -0.47 3.80 0.40 2.79 2.20 0.32 -0.34 119.74 128.44 2tss s LYS 36 Ca 0.06 -0.42 -0.06 0.00 -0.36 0.00 0.00 55.97 55.19 2tss s LYS 36 Cb -0.07 -3.32 -0.05 0.00 -1.51 0.00 0.00 37.83 32.88 2tss s LYS 36 CO -0.00 -0.03 0.70 -0.80 -0.36 0.00 0.00 175.35 174.86 2tss s ASN 37 N 1.19 6.40 0.59 1.43 0.01 0.26 -0.63 114.94 124.19 2tss s ASN 37 Ca 0.05 0.90 0.29 0.00 -0.71 0.00 0.00 52.86 53.39 2tss s ASN 37 Cb -0.14 -2.23 1.72 0.00 0.41 0.00 0.00 41.25 41.00 2tss s ASN 37 CO 0.04 -0.40 2.17 0.71 -1.51 0.00 0.00 177.10 178.11 2tss h THR 38 N 0.85 0.52 -0.00 1.60 1.35 -1.82 -0.27 112.91 115.13 2tss h THR 38 Ca -0.47 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.39 2tss h THR 38 Cb 1.20 0.92 0.00 0.00 -1.73 0.00 0.00 68.15 68.53 2tss h THR 38 CO 0.63 0.00 -0.02 -0.90 -0.25 0.00 0.00 175.52 174.99 2tss n ASP 39 N -3.86 0.10 0.00 5.36 5.68 -1.26 -4.90 116.55 117.67 2tss n ASP 39 Ca -0.01 -0.45 0.00 0.00 -0.50 0.00 0.00 54.79 53.83 2tss n ASP 39 Cb 0.21 -0.17 0.00 0.00 -1.14 0.00 0.00 41.12 40.01 2tss n ASP 39 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2tss n GLY 40 N 1.21 2.05 3.77 6.12 0.00 -0.11 -5.09 105.19 113.14 2tss n GLY 40 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 2tss n GLY 40 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2tss s SER 41 N -1.56 4.03 -0.04 1.61 1.04 -1.26 -4.75 113.70 112.78 2tss s SER 41 Ca 0.00 1.31 0.06 0.00 0.48 0.00 0.00 55.95 57.80 2tss s SER 41 Cb 0.00 -2.01 -0.02 0.00 0.10 0.00 0.00 66.02 64.09 2tss s SER 41 CO 0.00 -2.26 -0.22 -0.63 0.98 0.00 0.00 173.24 171.11 2tss s ILE 42 N -3.10 2.36 -0.14 -1.02 -1.09 -0.09 -0.57 121.20 117.55 2tss s ILE 42 Ca 0.62 -0.98 0.01 0.00 -2.23 0.00 0.00 60.65 58.07 2tss s ILE 42 Cb -0.16 -1.86 -0.00 0.00 -1.58 0.00 0.00 42.46 38.86 2tss s ILE 42 CO 0.55 0.58 -0.17 -0.44 -1.23 0.00 0.00 174.94 174.23 2tss s SER 43 N -0.49 3.60 -0.36 3.58 0.01 0.54 -0.15 113.70 120.43 2tss s SER 43 Ca 0.06 -0.46 -0.10 0.00 1.31 0.00 0.00 55.95 56.76 2tss s SER 43 Cb -0.11 -1.54 0.03 0.00 0.21 0.00 0.00 66.02 64.61 2tss s SER 43 CO 0.01 0.12 0.17 -0.76 0.41 0.00 0.00 173.24 173.19 2tss s LEU 44 N 0.60 4.59 -0.09 2.44 1.43 -0.04 -0.93 118.68 126.68 2tss s LEU 44 Ca -0.10 -1.03 0.02 0.00 -1.03 0.00 0.00 54.13 51.99 2tss s LEU 44 Cb -0.16 -1.97 -0.02 0.00 0.03 0.00 0.00 46.19 44.07 2tss s LEU 44 CO 0.03 -0.36 -0.14 -0.63 0.23 0.00 0.00 176.35 175.48 2tss s ILE 45 N 1.51 3.04 0.02 -0.59 1.01 -0.56 -1.69 121.20 123.94 2tss s ILE 45 Ca 0.01 -0.69 -0.02 0.00 0.00 0.00 0.00 60.65 59.94 2tss s ILE 45 Cb -0.19 -2.24 -0.04 0.00 0.01 0.00 0.00 42.46 40.00 2tss s ILE 45 CO 0.05 0.55 0.21 0.27 0.00 0.00 0.00 174.94 176.03 2tss s ILE 46 N -0.13 5.40 -0.37 2.92 -4.36 -0.81 -1.41 121.20 122.43 2tss s ILE 46 Ca -0.01 -0.21 0.01 0.00 -0.26 0.00 0.00 60.65 60.18 2tss s ILE 46 Cb -0.14 -3.58 0.12 0.00 1.25 0.00 0.00 42.46 40.11 2tss s ILE 46 CO 0.03 0.25 0.17 -0.36 0.24 0.00 0.00 174.94 175.27 2tss s PHE 47 N -1.41 1.77 -0.99 1.37 0.08 0.13 -1.70 117.98 117.24 2tss s PHE 47 Ca 0.31 -2.05 0.21 0.00 0.12 0.00 0.00 56.93 55.52 2tss s PHE 47 Cb -0.13 -1.74 0.90 0.00 -0.57 0.00 0.00 43.02 41.48 2tss s PHE 47 CO 0.22 -0.83 1.67 -2.30 -0.10 0.00 0.00 175.22 173.88 2tss n PRO 48 N 4.20 0.01 -3.84 0.24 -0.02 -1.26 -4.30 135.00 130.03 2tss n PRO 48 Ca 0.04 0.15 -0.36 0.00 -2.02 0.00 0.00 63.50 61.30 2tss n PRO 48 Cb 0.38 -1.51 -0.07 0.00 -0.02 0.00 0.00 33.50 32.28 2tss n PRO 48 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2tss s SER 49 N -3.05 6.31 0.30 2.55 0.15 -1.25 -4.62 113.70 114.10 2tss s SER 49 Ca 0.10 0.39 0.26 0.00 0.70 0.00 0.00 55.95 57.40 2tss s SER 49 Cb 0.14 -2.07 0.86 0.00 -1.71 0.00 0.00 66.02 63.24 2tss s SER 49 CO 0.39 0.34 1.76 1.55 1.20 0.00 0.00 173.24 178.47 2tss h PRO 50 N 5.52 0.00 0.00 5.44 0.13 -1.88 -3.07 132.00 138.14 2tss h PRO 50 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2tss h PRO 50 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2tss h PRO 50 CO 0.64 0.00 -0.50 0.66 -0.23 0.00 0.00 178.00 178.57 2tss n TYR 51 N -2.48 0.09 -3.40 1.56 4.01 -1.26 -4.42 117.16 111.26 2tss n TYR 51 Ca 0.04 0.03 -0.27 0.00 -0.16 0.00 0.00 57.90 57.53 2tss n TYR 51 Cb 0.37 -0.33 -0.10 0.00 -0.31 0.00 0.00 39.34 38.97 2tss n TYR 51 CO 0.00 0.00 0.00 0.98 -0.46 0.00 0.00 176.86 177.38 2tss n TYR 52 N -1.60 -0.72 -3.79 -0.72 9.36 -1.16 -3.67 117.16 114.87 2tss n TYR 52 Ca 0.05 -3.36 -0.36 0.00 3.32 0.00 0.00 57.90 57.55 2tss n TYR 52 Cb 0.35 0.19 -0.12 0.00 -0.63 0.00 0.00 39.34 39.14 2tss n TYR 52 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2tss s SER 53 N -0.09 5.23 0.15 2.98 0.15 -1.25 -4.51 113.70 116.35 2tss s SER 53 Ca 0.33 -1.93 -0.34 0.00 0.70 0.00 0.00 55.95 54.70 2tss s SER 53 Cb 0.05 -1.82 -0.14 0.00 -1.71 0.00 0.00 66.02 62.39 2tss s SER 53 CO -0.19 -0.51 1.53 -2.65 1.20 0.00 0.00 173.24 172.62 2tss n PRO 54 N 4.60 1.97 -0.39 5.44 -0.02 -1.26 -4.90 135.00 140.44 2tss n PRO 54 Ca -0.04 0.71 0.08 0.00 -2.02 0.00 0.00 63.50 62.23 2tss n PRO 54 Cb 0.42 -2.46 0.24 0.00 -0.02 0.00 0.00 33.50 31.68 2tss n PRO 54 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2tss n ALA 55 N 3.23 2.76 -1.78 3.55 0.00 -1.26 -4.99 120.51 122.02 2tss n ALA 55 Ca 0.17 -1.82 -0.41 0.00 0.00 0.00 0.00 53.44 51.38 2tss n ALA 55 Cb 0.27 -0.67 -0.01 0.00 0.00 0.00 0.00 19.45 19.04 2tss n ALA 55 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2tss s PHE 56 N -2.10 2.74 0.29 0.00 0.08 -1.26 -5.01 117.98 112.73 2tss s PHE 56 Ca 0.37 1.02 0.06 0.00 0.12 0.00 0.00 56.93 58.50 2tss s PHE 56 Cb 0.27 -3.99 -0.02 0.00 -0.57 0.00 0.00 43.02 38.71 2tss s PHE 56 CO 0.13 -3.09 0.41 0.95 -0.10 0.00 0.00 175.22 173.53 2tss s THR 57 N -0.56 4.59 0.09 0.64 -4.23 -1.26 -4.77 115.64 110.14 2tss s THR 57 Ca 0.57 -1.01 -0.36 0.00 -1.18 0.00 0.00 61.69 59.71 2tss s THR 57 Cb -0.46 -3.60 -0.17 0.00 1.34 0.00 0.00 72.50 69.61 2tss s THR 57 CO 0.54 -0.24 1.21 1.17 -0.54 0.00 0.00 174.62 176.76 2tss n LYS 58 N -1.53 0.84 0.00 3.99 4.81 -1.26 -1.60 118.16 123.42 2tss n LYS 58 Ca -0.04 0.30 0.00 0.00 -0.87 0.00 0.00 58.31 57.70 2tss n LYS 58 Cb 0.58 -1.86 0.00 0.00 0.02 0.00 0.00 35.03 33.77 2tss n LYS 58 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2tss n GLY 59 N 2.16 3.26 3.78 3.14 0.00 0.15 -4.97 105.19 112.71 2tss n GLY 59 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 2tss n GLY 59 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2tss s GLU 60 N -0.58 3.45 -0.04 1.61 2.02 -0.62 -4.68 118.70 119.86 2tss s GLU 60 Ca 0.00 1.55 -0.12 0.00 0.02 0.00 0.00 54.97 56.42 2tss s GLU 60 Cb 0.00 -2.03 -0.05 0.00 0.10 0.00 0.00 34.13 32.15 2tss s GLU 60 CO 0.00 -0.75 0.31 0.15 0.02 0.00 0.00 175.26 174.99 2tss s LYS 61 N -3.28 3.73 0.08 1.61 -0.14 -1.26 -1.33 119.74 119.14 2tss s LYS 61 Ca 0.71 0.20 -0.01 0.00 -1.36 0.00 0.00 55.97 55.52 2tss s LYS 61 Cb -0.22 -3.20 -0.04 0.00 -1.68 0.00 0.00 37.83 32.69 2tss s LYS 61 CO 0.25 0.72 -0.01 0.14 -0.76 0.00 0.00 175.35 175.69 2tss s VAL 62 N -1.08 0.26 -0.03 3.17 -7.23 -0.34 -4.40 120.40 110.75 2tss s VAL 62 Ca 0.21 -1.85 0.02 0.00 -1.81 0.00 0.00 61.98 58.55 2tss s VAL 62 Cb -0.15 -1.66 -0.03 0.00 0.56 0.00 0.00 36.38 35.09 2tss s VAL 62 CO 0.10 -0.86 -0.04 -1.81 -0.31 0.00 0.00 175.10 172.18 2tss s ASP 63 N -2.97 4.84 -0.14 4.85 1.01 -0.38 -1.00 116.67 122.89 2tss s ASP 63 Ca 0.12 -0.04 0.02 0.00 0.71 0.00 0.00 52.55 53.35 2tss s ASP 63 Cb 0.08 -1.22 0.00 0.00 1.01 0.00 0.00 42.92 42.79 2tss s ASP 63 CO -0.07 0.31 -0.19 -0.76 0.21 0.00 0.00 175.17 174.68 2tss s LEU 64 N -1.24 2.32 -0.39 1.23 1.02 0.28 -2.03 118.68 119.85 2tss s LEU 64 Ca 0.16 -0.51 0.02 0.00 0.02 0.00 0.00 54.13 53.82 2tss s LEU 64 Cb -0.11 -1.50 0.15 0.00 0.02 0.00 0.00 46.19 44.75 2tss s LEU 64 CO 0.06 0.11 0.27 0.20 0.02 0.00 0.00 176.35 177.01 2tss s ASN 65 N 0.67 2.43 0.38 2.29 -0.87 -0.54 -1.54 114.94 117.75 2tss s ASN 65 Ca -0.09 -2.61 0.05 0.00 -1.57 0.00 0.00 52.86 48.64 2tss s ASN 65 Cb -0.16 -0.48 -0.02 0.00 -0.02 0.00 0.00 41.25 40.56 2tss s ASN 65 CO 0.02 -0.25 0.20 0.28 -2.57 0.00 0.00 177.10 174.78 2tss s THR 66 N 0.56 0.30 0.01 1.60 -1.32 -0.48 -4.36 115.64 111.95 2tss s THR 66 Ca 0.24 -2.00 0.09 0.00 -1.21 0.00 0.00 61.69 58.81 2tss s THR 66 Cb -0.12 -2.38 -0.02 0.00 -1.51 0.00 0.00 72.50 68.46 2tss s THR 66 CO -0.08 0.00 -0.26 -0.54 -2.21 0.00 0.00 174.62 171.53 2tss s LYS 67 N -3.57 1.97 0.19 7.08 -0.14 -1.25 -0.38 119.74 123.63 2tss s LYS 67 Ca 0.30 -1.02 -0.26 0.00 -1.36 0.00 0.00 55.97 53.64 2tss s LYS 67 Cb 0.02 -2.02 -0.08 0.00 -1.68 0.00 0.00 37.83 34.07 2tss s LYS 67 CO 0.20 0.54 0.82 -0.98 -0.76 0.00 0.00 175.35 175.17 2tss s ARG 68 N -0.92 4.61 0.01 1.68 1.70 -1.26 -1.76 118.95 123.01 2tss s ARG 68 Ca 0.11 1.22 0.22 0.00 -0.47 0.00 0.00 55.73 56.81 2tss s ARG 68 Cb -0.10 -3.22 -0.13 0.00 -0.57 0.00 0.00 34.95 30.93 2tss s ARG 68 CO 0.01 0.54 0.88 0.25 -1.08 0.00 0.00 175.30 175.89 2tss n THR 69 N 1.47 0.05 -3.68 4.99 -2.24 0.10 -4.93 114.28 110.03 2tss n THR 69 Ca -0.04 -0.17 -0.03 0.00 -2.27 0.00 0.00 64.05 61.54 2tss n THR 69 Cb 0.48 0.53 -0.01 0.00 -2.10 0.00 0.00 70.33 69.23 2tss n THR 69 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 2tss s LYS 70 N -3.16 0.91 0.31 -0.78 -2.85 -1.26 -5.09 119.74 107.83 2tss s LYS 70 Ca 0.04 -0.48 -0.29 0.00 -1.00 0.00 0.00 55.97 54.23 2tss s LYS 70 Cb 0.15 0.33 -0.12 0.00 -2.06 0.00 0.00 37.83 36.13 2tss s LYS 70 CO 0.85 -0.42 1.37 1.17 0.10 0.00 0.00 175.35 178.43 2tss n LYS 71 N -0.43 2.20 -1.20 1.78 4.81 -1.26 -4.51 118.16 119.56 2tss n LYS 71 Ca -0.07 0.78 -0.32 0.00 -0.87 0.00 0.00 58.31 57.83 2tss n LYS 71 Cb 0.61 -2.41 0.11 0.00 0.02 0.00 0.00 35.03 33.36 2tss n LYS 71 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 2tss s SER 72 N -0.02 4.01 0.04 3.14 0.01 -1.26 -4.80 113.70 114.81 2tss s SER 72 Ca 0.60 2.10 0.07 0.00 1.31 0.00 0.00 55.95 60.03 2tss s SER 72 Cb -0.58 -2.56 -0.02 0.00 0.21 0.00 0.00 66.02 63.07 2tss s SER 72 CO 0.57 -2.37 -0.19 -1.10 0.41 0.00 0.00 173.24 170.56 2tss s GLN 73 N -4.46 1.27 -0.17 12.44 -0.21 -0.33 -4.96 119.66 123.23 2tss s GLN 73 Ca 0.67 -0.88 -0.12 0.00 0.02 0.00 0.00 55.36 55.06 2tss s GLN 73 Cb -0.22 -1.35 -0.05 0.00 1.00 0.00 0.00 33.01 32.39 2tss s GLN 73 CO 0.52 0.34 0.21 -1.01 -2.12 0.00 0.00 175.29 173.23 2tss s HIS 74 N -0.79 3.45 0.46 0.91 3.76 -1.26 -0.38 115.29 121.43 2tss s HIS 74 Ca 0.06 0.47 -0.00 0.00 -0.15 0.00 0.00 55.06 55.44 2tss s HIS 74 Cb -0.08 -2.23 -0.00 0.00 1.11 0.00 0.00 32.58 31.37 2tss s HIS 74 CO 0.02 0.29 0.69 0.95 -0.85 0.00 0.00 174.74 175.84 2tss s THR 75 N 0.32 3.96 0.51 1.30 -4.23 0.95 -4.95 115.64 113.49 2tss s THR 75 Ca 0.12 -0.46 0.18 0.00 -1.18 0.00 0.00 61.69 60.36 2tss s THR 75 Cb -0.12 -3.47 0.26 0.00 1.34 0.00 0.00 72.50 70.51 2tss s THR 75 CO 0.01 -0.34 2.12 0.77 -0.54 0.00 0.00 174.62 176.64 2tss h SER 76 N 0.35 0.00 1.18 3.99 4.64 -1.99 0.69 113.55 122.42 2tss h SER 76 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2tss h SER 76 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2tss h SER 76 CO 0.57 0.05 0.00 -0.62 -0.87 0.00 0.00 176.83 175.97 2tss n GLU 77 N -4.33 0.11 0.00 4.77 4.71 -1.26 -4.91 120.64 119.73 2tss n GLU 77 Ca -0.03 0.10 0.00 0.00 -0.01 0.00 0.00 57.16 57.22 2tss n GLU 77 Cb 0.13 -1.63 0.00 0.00 -1.01 0.00 0.00 31.44 28.94 2tss n GLU 77 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2tss n GLY 78 N 1.38 1.02 3.83 0.62 0.00 0.24 -5.09 105.19 107.18 2tss n GLY 78 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 2tss n GLY 78 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2tss s THR 79 N -2.00 4.76 -0.27 2.61 -4.23 -1.26 -4.79 115.64 110.47 2tss s THR 79 Ca 0.00 1.02 -0.09 0.00 -1.18 0.00 0.00 61.69 61.44 2tss s THR 79 Cb 0.00 -3.80 -0.03 0.00 1.34 0.00 0.00 72.50 70.01 2tss s THR 79 CO 0.00 0.30 0.13 -0.47 -0.54 0.00 0.00 174.62 174.04 2tss s TYR 80 N -1.40 3.15 -0.15 3.99 6.14 -1.26 -0.03 117.35 127.79 2tss s TYR 80 Ca 0.37 -0.24 -0.02 0.00 0.64 0.00 0.00 57.07 57.82 2tss s TYR 80 Cb -0.16 -2.31 -0.02 0.00 0.42 0.00 0.00 41.96 39.89 2tss s TYR 80 CO 0.20 -0.30 -0.08 0.42 0.64 0.00 0.00 175.55 176.42 2tss s ILE 81 N 1.67 3.45 -0.01 3.14 1.01 0.48 -0.91 121.20 130.04 2tss s ILE 81 Ca 0.06 -0.51 -0.03 0.00 0.00 0.00 0.00 60.65 60.17 2tss s ILE 81 Cb -0.16 -2.49 -0.04 0.00 0.01 0.00 0.00 42.46 39.78 2tss s ILE 81 CO 0.07 0.50 0.19 -1.00 0.00 0.00 0.00 174.94 174.70 2tss s HIS 82 N 0.43 3.55 -0.26 3.97 3.76 0.79 -1.19 115.29 126.34 2tss s HIS 82 Ca -0.07 0.37 0.02 0.00 -0.15 0.00 0.00 55.06 55.23 2tss s HIS 82 Cb -0.15 -1.84 0.05 0.00 1.11 0.00 0.00 32.58 31.75 2tss s HIS 82 CO 0.04 0.64 -0.09 -0.06 -0.85 0.00 0.00 174.74 174.42 2tss s PHE 83 N -1.33 3.22 0.36 1.40 0.08 -1.26 -0.86 117.98 119.58 2tss s PHE 83 Ca 0.27 -2.13 0.03 0.00 0.12 0.00 0.00 56.93 55.23 2tss s PHE 83 Cb -0.13 -1.97 -0.04 0.00 -0.57 0.00 0.00 43.02 40.31 2tss s PHE 83 CO 0.19 -0.85 0.11 -0.65 -0.10 0.00 0.00 175.22 173.91 2tss s GLN 84 N 1.16 1.76 -0.05 0.44 -0.21 -0.68 -0.72 119.66 121.36 2tss s GLN 84 Ca -0.07 -2.03 -0.01 0.00 0.02 0.00 0.00 55.36 53.28 2tss s GLN 84 Cb -0.19 -0.62 0.03 0.00 1.00 0.00 0.00 33.01 33.23 2tss s GLN 84 CO -0.05 -0.36 0.01 -1.50 -2.12 0.00 0.00 175.29 171.26 2tss s ILE 85 N -3.33 0.25 0.00 1.08 2.07 -0.72 -1.93 121.20 118.62 2tss s ILE 85 Ca 0.30 0.14 0.00 0.00 -1.41 0.00 0.00 60.65 59.68 2tss s ILE 85 Cb 0.05 -0.39 0.00 0.00 0.13 0.00 0.00 42.46 42.25 2tss s ILE 85 CO 0.15 0.21 0.00 -0.24 -1.91 0.00 0.00 174.94 173.15 2tss n SER 86 N 4.73 -3.95 -1.17 4.50 2.88 -0.69 -3.96 113.62 115.97 2tss n SER 86 Ca -0.14 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 57.33 2tss n SER 86 Cb 0.50 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.98 2tss n SER 86 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2tss n GLY 87 N 0.00 0.41 3.29 0.46 0.00 -1.26 -4.65 105.19 103.44 2tss n GLY 87 Ca 0.00 -0.48 -0.33 0.00 0.00 0.00 0.00 46.02 45.20 2tss n GLY 87 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2tss s VAL 88 N -2.86 2.86 0.33 1.61 1.01 -1.26 -1.47 120.40 120.63 2tss s VAL 88 Ca 0.12 -0.70 0.04 0.00 0.00 0.00 0.00 61.98 61.43 2tss s VAL 88 Cb -0.05 -2.23 -0.04 0.00 0.00 0.00 0.00 36.38 34.06 2tss s VAL 88 CO 0.14 0.50 0.15 0.42 0.00 0.00 0.00 175.10 176.31 2tss s THR 89 N 0.87 0.47 1.03 3.92 -4.23 -0.86 -4.89 115.64 111.95 2tss s THR 89 Ca -0.04 -2.00 -0.16 0.00 -1.18 0.00 0.00 61.69 58.31 2tss s THR 89 Cb -0.15 -2.50 0.21 0.00 1.34 0.00 0.00 72.50 71.40 2tss s THR 89 CO -0.00 0.00 1.19 0.54 -0.54 0.00 0.00 174.62 175.81 2tss s ASN 90 N -3.45 2.45 0.00 3.99 2.20 -1.26 -1.25 114.94 117.62 2tss s ASN 90 Ca 0.33 0.61 0.20 0.00 -0.94 0.00 0.00 52.86 53.06 2tss s ASN 90 Cb 0.05 -0.88 0.53 0.00 -2.00 0.00 0.00 41.25 38.95 2tss s ASN 90 CO 0.17 -3.18 1.44 0.35 -2.94 0.00 0.00 177.10 172.94 2tss n THR 91 N -4.12 0.52 -1.76 0.54 -2.24 -1.26 -4.21 114.28 101.75 2tss n THR 91 Ca 0.12 -0.64 -0.42 0.00 -2.27 0.00 0.00 64.05 60.85 2tss n THR 91 Cb 0.59 0.58 -0.02 0.00 -2.10 0.00 0.00 70.33 69.38 2tss n THR 91 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2tss s GLU 92 N -1.48 4.12 0.20 -0.78 2.02 -1.26 -4.96 118.70 116.56 2tss s GLU 92 Ca 0.36 2.59 0.06 0.00 0.02 0.00 0.00 54.97 58.00 2tss s GLU 92 Cb 0.20 -3.04 -0.04 0.00 0.10 0.00 0.00 34.13 31.35 2tss s GLU 92 CO 0.28 -0.68 0.12 0.15 0.02 0.00 0.00 175.26 175.14 2tss s LYS 93 N 0.18 2.76 0.46 1.61 -0.14 -1.26 -1.29 119.74 122.06 2tss s LYS 93 Ca 0.68 -1.01 -0.07 0.00 -1.36 0.00 0.00 55.97 54.21 2tss s LYS 93 Cb -0.49 -2.53 -0.04 0.00 -1.68 0.00 0.00 37.83 33.09 2tss s LYS 93 CO 0.41 0.44 0.78 -0.51 -0.76 0.00 0.00 175.35 175.72 2tss s LEU 94 N -3.33 3.68 0.23 3.17 1.43 0.71 -4.62 118.68 119.96 2tss s LEU 94 Ca 0.31 0.99 -0.07 0.00 -1.03 0.00 0.00 54.13 54.33 2tss s LEU 94 Cb -0.09 -3.92 0.30 0.00 0.03 0.00 0.00 46.19 42.51 2tss s LEU 94 CO 0.23 -0.53 1.85 -0.65 0.23 0.00 0.00 176.35 177.48 2tss h PRO 95 N 0.53 0.92 -3.54 1.29 0.11 -2.00 -3.43 132.00 125.88 2tss h PRO 95 Ca -0.47 -0.06 -0.19 0.00 0.11 0.00 0.00 66.00 65.39 2tss h PRO 95 Cb 1.20 -0.21 -0.26 0.00 0.11 0.00 0.00 31.00 31.84 2tss h PRO 95 CO 0.62 0.61 -0.60 0.95 -0.21 0.00 0.00 178.00 179.37 2tss s THR 96 N -6.08 0.02 0.40 -1.15 -4.23 -1.26 -5.14 115.64 98.20 2tss s THR 96 Ca -0.13 -0.17 -0.26 0.00 -1.18 0.00 0.00 61.69 59.96 2tss s THR 96 Cb 0.18 -0.19 -0.11 0.00 1.34 0.00 0.00 72.50 73.72 2tss s THR 96 CO 0.79 -0.09 1.19 -2.65 -0.54 0.00 0.00 174.62 173.31 2tss n PRO 97 N 2.70 1.77 -4.41 3.99 -0.02 -1.26 -4.90 135.00 132.87 2tss n PRO 97 Ca -0.15 0.63 -0.25 0.00 -2.02 0.00 0.00 63.50 61.71 2tss n PRO 97 Cb 0.58 -2.24 -0.09 0.00 -0.02 0.00 0.00 33.50 31.73 2tss n PRO 97 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 2tss s ILE 98 N -1.19 2.50 -0.17 4.25 -4.36 0.22 -4.87 121.20 117.59 2tss s ILE 98 Ca 0.60 -2.07 -0.03 0.00 -0.26 0.00 0.00 60.65 58.89 2tss s ILE 98 Cb -0.55 -2.72 -0.02 0.00 1.25 0.00 0.00 42.46 40.42 2tss s ILE 98 CO 0.59 -0.21 -0.06 -0.70 0.24 0.00 0.00 174.94 174.80 2tss s GLU 99 N -3.67 3.53 -0.01 0.37 2.56 -1.26 -0.77 118.70 119.45 2tss s GLU 99 Ca 0.34 -0.58 -0.25 0.00 0.00 0.00 0.00 54.97 54.47 2tss s GLU 99 Cb 0.00 -2.89 -0.04 0.00 2.00 0.00 0.00 34.13 33.20 2tss s GLU 99 CO 0.18 0.10 0.78 -0.51 -0.56 0.00 0.00 175.26 175.25 2tss s LEU 100 N 0.71 4.38 -0.86 2.70 1.43 -1.26 -4.98 118.68 120.79 2tss s LEU 100 Ca -0.03 1.38 -0.25 0.00 -1.03 0.00 0.00 54.13 54.20 2tss s LEU 100 Cb -0.15 -3.23 -0.02 0.00 0.03 0.00 0.00 46.19 42.83 2tss s LEU 100 CO 0.02 -0.09 1.78 -2.84 0.23 0.00 0.00 176.35 175.45 2tss s PRO 101 N 0.49 2.83 -0.23 1.29 0.02 -1.26 -4.96 135.00 133.17 2tss s PRO 101 Ca 0.40 -0.30 -0.08 0.00 0.02 0.00 0.00 61.00 61.05 2tss s PRO 101 Cb -0.19 -4.94 -0.04 0.00 0.02 0.00 0.00 34.50 29.35 2tss s PRO 101 CO 0.22 -2.93 0.09 -1.17 -0.33 0.00 0.00 177.00 172.89 2tss s LEU 102 N 8.51 3.72 -0.15 -5.54 2.96 -1.26 -1.49 118.68 125.43 2tss s LEU 102 Ca 0.62 -0.04 -0.00 0.00 -0.22 0.00 0.00 54.13 54.48 2tss s LEU 102 Cb -0.06 -1.98 -0.01 0.00 0.50 0.00 0.00 46.19 44.63 2tss s LEU 102 CO 0.02 0.05 -0.13 -0.54 -1.32 0.00 0.00 176.35 174.43 2tss s LYS 103 N 1.13 3.32 -0.09 1.98 3.01 -0.36 -4.94 119.74 123.79 2tss s LYS 103 Ca 0.05 -0.70 0.03 0.00 -1.01 0.00 0.00 55.97 54.34 2tss s LYS 103 Cb -0.14 -2.68 -0.01 0.00 -1.01 0.00 0.00 37.83 33.99 2tss s LYS 103 CO 0.04 0.09 -0.18 0.08 0.51 0.00 0.00 175.35 175.89 2tss s VAL 104 N 0.67 2.70 -0.06 3.17 1.01 -1.26 -1.21 120.40 125.42 2tss s VAL 104 Ca -0.07 -0.82 0.04 0.00 0.00 0.00 0.00 61.98 61.14 2tss s VAL 104 Cb -0.15 -2.07 -0.00 0.00 0.00 0.00 0.00 36.38 34.15 2tss s VAL 104 CO 0.02 0.55 -0.19 -0.54 0.00 0.00 0.00 175.10 174.95 2tss s LYS 105 N -0.02 2.08 -0.18 2.72 1.02 -0.32 -0.53 119.74 124.51 2tss s LYS 105 Ca -0.05 -0.66 0.01 0.00 0.02 0.00 0.00 55.97 55.28 2tss s LYS 105 Cb -0.14 -1.73 0.02 0.00 -0.52 0.00 0.00 37.83 35.46 2tss s LYS 105 CO 0.04 0.22 -0.17 0.08 -0.92 0.00 0.00 175.35 174.60 2tss s VAL 106 N 0.15 1.93 -1.42 3.17 1.01 0.07 -0.75 120.40 124.55 2tss s VAL 106 Ca -0.08 -0.92 -0.04 0.00 0.00 0.00 0.00 61.98 60.94 2tss s VAL 106 Cb -0.13 -1.79 0.03 0.00 0.00 0.00 0.00 36.38 34.48 2tss s VAL 106 CO 0.04 0.46 0.67 1.41 0.00 0.00 0.00 175.10 177.67 2tss n HIS 107 N 4.64 -1.89 -0.16 5.22 8.25 -0.59 -1.20 115.22 129.49 2tss n HIS 107 Ca -0.19 0.82 0.00 0.00 -0.26 0.00 0.00 57.72 58.09 2tss n HIS 107 Cb 0.49 -3.96 0.00 0.00 1.12 0.00 0.00 29.99 27.64 2tss n HIS 107 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2tss n GLY 108 N -1.72 2.22 3.67 -1.41 0.00 -1.26 -5.00 105.19 101.69 2tss n GLY 108 Ca -0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 2tss n GLY 108 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2tss s LYS 109 N -0.03 2.91 0.21 1.61 2.20 -0.34 -5.04 119.74 121.26 2tss s LYS 109 Ca 0.00 -0.47 -0.32 0.00 -0.36 0.00 0.00 55.97 54.82 2tss s LYS 109 Cb 0.00 -2.74 -0.14 0.00 -1.51 0.00 0.00 37.83 33.44 2tss s LYS 109 CO 0.00 0.68 1.36 -3.47 -0.36 0.00 0.00 175.35 173.56 2tss n ASP 110 N 1.99 2.37 -3.78 1.43 -0.08 -1.26 -0.75 116.55 116.47 2tss n ASP 110 Ca -0.18 1.14 -0.29 0.00 -1.51 0.00 0.00 54.79 53.95 2tss n ASP 110 Cb 0.53 -1.36 -0.16 0.00 2.34 0.00 0.00 41.12 42.47 2tss n ASP 110 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 2tss s SER 111 N 0.27 3.48 0.33 1.67 0.15 0.31 -4.83 113.70 115.07 2tss s SER 111 Ca 0.71 -1.16 -0.28 0.00 0.70 0.00 0.00 55.95 55.92 2tss s SER 111 Cb -0.72 -0.82 -0.13 0.00 -1.71 0.00 0.00 66.02 62.65 2tss s SER 111 CO 0.49 -0.32 1.28 -0.81 1.20 0.00 0.00 173.24 175.08 2tss n PRO 112 N 4.90 2.06 -1.98 5.44 -0.04 -1.26 -4.30 135.00 139.82 2tss n PRO 112 Ca -0.07 0.72 -0.32 0.00 -0.04 0.00 0.00 63.50 63.79 2tss n PRO 112 Cb 0.45 -2.29 0.01 0.00 -0.04 0.00 0.00 33.50 31.62 2tss n PRO 112 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2tss s LEU 113 N -0.81 3.40 -0.13 1.53 1.43 -1.26 -5.03 118.68 117.81 2tss s LEU 113 Ca 0.57 1.67 -0.05 0.00 -1.03 0.00 0.00 54.13 55.29 2tss s LEU 113 Cb -0.58 -4.51 0.06 0.00 0.03 0.00 0.00 46.19 41.19 2tss s LEU 113 CO 0.61 -1.08 0.26 -0.75 0.23 0.00 0.00 176.35 175.62 2tss s LYS 114 N -4.45 0.16 -1.17 1.70 2.47 -1.26 -4.89 119.74 112.30 2tss s LYS 114 Ca 0.60 0.71 -0.08 0.00 -1.56 0.00 0.00 55.97 55.65 2tss s LYS 114 Cb -0.14 -0.04 0.01 0.00 -1.46 0.00 0.00 37.83 36.20 2tss s LYS 114 CO 0.42 -0.26 1.03 0.66 0.16 0.00 0.00 175.35 177.36 2tss n TYR 115 N 5.13 -2.50 -2.88 4.03 4.01 -1.26 -4.96 117.16 118.74 2tss n TYR 115 Ca -0.10 0.88 -0.43 0.00 -0.16 0.00 0.00 57.90 58.09 2tss n TYR 115 Cb 0.50 -4.50 -0.04 0.00 -0.31 0.00 0.00 39.34 34.98 2tss n TYR 115 CO 0.00 0.00 0.00 -0.46 -0.46 0.00 0.00 176.86 175.94 2tss s TRP 116 N -3.28 3.01 0.80 -0.72 -0.00 -1.26 -5.03 118.94 112.46 2tss s TRP 116 Ca 0.50 0.45 -0.11 0.00 -0.00 0.00 0.00 56.10 56.94 2tss s TRP 116 Cb -0.22 -3.73 0.07 0.00 -0.00 0.00 0.00 33.47 29.59 2tss s TRP 116 CO 0.63 -0.95 1.09 -1.25 -0.00 0.00 0.00 176.95 176.47 2tss s PRO 117 N 3.47 2.07 0.47 5.86 0.04 -1.26 -5.05 135.00 140.60 2tss s PRO 117 Ca 0.35 0.85 -0.00 0.00 0.04 0.00 0.00 61.00 62.23 2tss s PRO 117 Cb -0.11 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.53 2tss s PRO 117 CO 0.22 -1.68 0.70 0.15 0.04 0.00 0.00 177.00 176.42 2tss s LYS 118 N -5.03 3.01 -0.02 4.56 1.02 -1.26 -4.69 119.74 117.33 2tss s LYS 118 Ca 0.61 -0.48 0.03 0.00 0.02 0.00 0.00 55.97 56.15 2tss s LYS 118 Cb -0.16 -2.53 -0.00 0.00 -0.52 0.00 0.00 37.83 34.62 2tss s LYS 118 CO 0.55 -0.34 -0.11 -0.06 -0.92 0.00 0.00 175.35 174.47 2tss s PHE 119 N -2.61 1.08 -0.32 3.18 0.08 0.05 -4.91 117.98 114.54 2tss s PHE 119 Ca 0.50 -0.24 0.04 0.00 0.12 0.00 0.00 56.93 57.35 2tss s PHE 119 Cb -0.10 -0.73 0.12 0.00 -0.57 0.00 0.00 43.02 41.74 2tss s PHE 119 CO 0.38 -0.06 1.10 -0.40 -0.10 0.00 0.00 175.22 176.14 2tss n ASP 120 N 3.00 2.35 -4.85 1.36 5.75 -1.26 -0.61 116.55 122.29 2tss n ASP 120 Ca -0.16 -2.04 -0.38 0.00 -0.01 0.00 0.00 54.79 52.20 2tss n ASP 120 Cb 0.55 -0.10 -0.06 0.00 -1.03 0.00 0.00 41.12 40.48 2tss n ASP 120 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2tss s LYS 121 N -1.07 3.72 0.16 0.11 1.02 -1.26 -0.21 119.74 122.21 2tss s LYS 121 Ca 0.09 0.19 -0.14 0.00 0.02 0.00 0.00 55.97 56.14 2tss s LYS 121 Cb 0.05 -3.21 0.04 0.00 -0.52 0.00 0.00 37.83 34.20 2tss s LYS 121 CO 0.06 0.73 1.72 -0.22 -0.92 0.00 0.00 175.35 176.71 2tss h LYS 122 N 4.80 0.76 -5.92 1.68 1.63 -1.45 -3.44 116.57 114.64 2tss h LYS 122 Ca -0.53 -0.13 -0.54 0.00 -0.85 0.00 0.00 60.65 58.60 2tss h LYS 122 Cb 1.22 -0.13 -0.24 0.00 -0.60 0.00 0.00 32.23 32.48 2tss h LYS 122 CO 0.60 0.66 -0.82 1.14 -3.45 0.00 0.00 179.45 177.58 2tss s GLN 123 N -5.59 1.19 0.01 1.90 -2.07 -1.26 -1.63 119.66 112.22 2tss s GLN 123 Ca -0.13 -0.97 0.01 0.00 -1.82 0.00 0.00 55.36 52.45 2tss s GLN 123 Cb 0.12 -1.33 -0.01 0.00 -1.09 0.00 0.00 33.01 30.70 2tss s GLN 123 CO 0.77 0.33 -0.05 -0.51 -1.32 0.00 0.00 175.29 174.51 2tss s LEU 124 N -1.41 2.10 0.59 2.60 1.43 -0.86 -4.88 118.68 118.24 2tss s LEU 124 Ca 0.06 -0.25 -0.18 0.00 -1.03 0.00 0.00 54.13 52.73 2tss s LEU 124 Cb -0.09 -0.17 -0.04 0.00 0.03 0.00 0.00 46.19 45.92 2tss s LEU 124 CO 0.02 -0.05 1.11 0.00 0.23 0.00 0.00 176.35 177.66 2tss s ALA 125 N -0.58 2.63 0.34 4.21 0.00 -1.26 -1.86 121.76 125.24 2tss s ALA 125 Ca -0.03 0.66 0.04 0.00 0.00 0.00 0.00 51.96 52.64 2tss s ALA 125 Cb -0.05 -3.32 0.61 0.00 0.00 0.00 0.00 23.12 20.36 2tss s ALA 125 CO -0.00 -0.92 1.88 0.82 0.00 0.00 0.00 175.76 177.54 2tss h ILE 126 N 0.73 1.19 -0.06 0.00 2.04 -1.84 -1.78 117.51 117.80 2tss h ILE 126 Ca -0.48 -0.76 -0.07 0.00 1.00 0.00 0.00 64.86 64.55 2tss h ILE 126 Cb 1.25 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 38.24 2tss h ILE 126 CO 0.56 0.26 -0.28 0.77 0.00 0.00 0.00 178.15 179.46 2tss h SER 127 N 0.51 0.10 -0.19 1.72 4.64 -1.92 0.78 113.55 119.20 2tss h SER 127 Ca 0.11 -0.03 -0.05 0.00 -0.47 0.00 0.00 61.79 61.35 2tss h SER 127 Cb 0.31 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.37 2tss h SER 127 CO 0.01 0.39 -0.09 0.74 -0.87 0.00 0.00 176.83 177.01 2tss h THR 128 N 0.10 1.30 -0.80 2.95 2.02 -1.61 -1.30 112.91 115.57 2tss h THR 128 Ca 0.01 -1.13 -0.02 0.00 0.77 0.00 0.00 66.41 66.04 2tss h THR 128 Cb 0.56 1.64 -0.04 0.00 -1.74 0.00 0.00 68.15 68.57 2tss h THR 128 CO 0.04 0.34 0.43 -0.07 0.37 0.00 0.00 175.52 176.63 2tss h LEU 129 N 0.10 1.01 0.00 2.58 3.38 -0.99 -0.68 115.31 120.71 2tss h LEU 129 Ca 0.04 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 57.93 2tss h LEU 129 Cb 0.57 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 2tss h LEU 129 CO 0.03 0.82 -0.09 -0.78 0.09 0.00 0.00 178.44 178.51 2tss h ASP 130 N 1.11 -0.26 0.24 -0.43 3.58 -0.70 -0.93 116.42 119.04 2tss h ASP 130 Ca 0.28 0.04 -0.09 0.00 0.42 0.00 0.00 57.03 57.68 2tss h ASP 130 Cb 0.05 0.11 -0.01 0.00 1.72 0.00 0.00 39.33 41.19 2tss h ASP 130 CO -0.04 -0.13 -0.36 2.19 -2.88 0.00 0.00 179.24 178.02 2tss h PHE 131 N -0.15 0.21 -0.30 0.28 -5.15 -0.85 -1.46 116.94 109.52 2tss h PHE 131 Ca 0.03 -0.05 -0.03 0.00 -0.20 0.00 0.00 57.97 57.72 2tss h PHE 131 Cb 0.20 -0.05 -0.01 0.00 0.22 0.00 0.00 35.95 36.31 2tss h PHE 131 CO -0.15 0.53 0.06 0.93 -2.00 0.00 0.00 178.31 177.67 2tss h GLU 132 N 0.16 0.49 0.01 6.09 4.39 -0.82 0.09 114.58 124.98 2tss h GLU 132 Ca 0.02 -0.12 -0.00 0.00 0.34 0.00 0.00 59.36 59.59 2tss h GLU 132 Cb 0.72 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.31 2tss h GLU 132 CO 0.05 0.58 -0.00 0.82 -1.16 0.00 0.00 179.01 179.30 2tss h ILE 133 N 0.32 1.15 -0.32 3.13 2.04 -1.06 -2.73 117.51 120.04 2tss h ILE 133 Ca 0.09 -0.47 -0.09 0.00 1.00 0.00 0.00 64.86 65.39 2tss h ILE 133 Cb 0.32 1.47 -0.02 0.00 -0.74 0.00 0.00 36.82 37.85 2tss h ILE 133 CO 0.00 0.12 -0.16 0.03 0.00 0.00 0.00 178.15 178.14 2tss h ARG 134 N -0.21 0.58 -0.86 2.37 3.08 -1.24 -1.94 114.38 116.16 2tss h ARG 134 Ca -0.00 -0.19 -0.03 0.00 0.07 0.00 0.00 59.98 59.83 2tss h ARG 134 Cb 0.21 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.17 2tss h ARG 134 CO 0.00 0.72 0.44 1.25 -1.07 0.00 0.00 179.97 181.31 2tss h HIS 135 N 0.52 1.22 -0.61 3.04 2.76 -0.97 0.17 115.15 121.28 2tss h HIS 135 Ca 0.09 -0.05 -0.07 0.00 -2.20 0.00 0.00 60.37 58.14 2tss h HIS 135 Cb 0.58 -0.38 -0.03 0.00 1.55 0.00 0.00 27.41 29.14 2tss h HIS 135 CO 0.02 0.87 0.11 0.37 -1.30 0.00 0.00 177.93 178.00 2tss h GLN 136 N 1.22 0.99 -0.43 5.26 5.75 -1.14 -1.15 115.11 125.60 2tss h GLN 136 Ca 0.30 -0.24 -0.13 0.00 -0.15 0.00 0.00 58.65 58.42 2tss h GLN 136 Cb 0.09 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 28.50 2tss h GLN 136 CO -0.04 0.91 -0.25 -0.07 -2.65 0.00 0.00 178.83 176.72 2tss h LEU 137 N 0.93 0.97 -0.16 -2.39 3.38 -0.55 -1.09 115.31 116.40 2tss h LEU 137 Ca 0.19 -0.42 -0.23 0.00 0.09 0.00 0.00 57.88 57.52 2tss h LEU 137 Cb 0.40 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 40.89 2tss h LEU 137 CO 0.01 1.17 -0.81 0.71 0.09 0.00 0.00 178.44 179.62 2tss h THR 138 N 0.76 1.28 0.12 0.22 1.35 -0.59 -1.60 112.91 114.47 2tss h THR 138 Ca 0.09 -2.01 -0.29 0.00 -0.55 0.00 0.00 66.41 63.65 2tss h THR 138 Cb 0.83 2.03 0.03 0.00 -1.73 0.00 0.00 68.15 69.31 2tss h THR 138 CO 0.07 0.64 -1.20 1.56 -0.25 0.00 0.00 175.52 176.34 2tss h GLN 139 N 0.51 0.59 0.00 4.72 1.08 -1.23 -3.32 115.11 117.47 2tss h GLN 139 Ca -0.06 -0.81 -0.36 0.00 -1.45 0.00 0.00 58.65 55.97 2tss h GLN 139 Cb 1.44 0.27 -0.07 0.00 -0.05 0.00 0.00 27.48 29.07 2tss h GLN 139 CO 0.16 1.37 -2.36 -0.89 -0.95 0.00 0.00 178.83 176.16 2tss n ILE 140 N -3.83 1.36 -0.58 2.54 2.08 -0.42 -4.66 119.36 115.85 2tss n ILE 140 Ca -0.14 -0.75 0.07 0.00 0.56 0.00 0.00 62.75 62.49 2tss n ILE 140 Cb 0.97 -0.72 0.21 0.00 -0.75 0.00 0.00 39.64 39.34 2tss n ILE 140 CO 0.00 0.00 0.00 1.41 0.56 0.00 0.00 176.55 178.52 2tss n HIS 141 N -2.86 0.71 -1.12 1.39 8.25 -0.67 -5.00 115.22 115.93 2tss n HIS 141 Ca -0.35 -0.68 -0.04 0.00 -0.26 0.00 0.00 57.72 56.39 2tss n HIS 141 Cb 1.09 -0.17 -0.02 0.00 1.12 0.00 0.00 29.99 32.01 2tss n HIS 141 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2tss n GLY 142 N 0.02 0.63 3.73 -1.41 0.00 -0.97 -4.93 105.19 102.26 2tss n GLY 142 Ca 0.16 -0.25 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 2tss n GLY 142 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2tss s LEU 143 N -0.93 4.36 0.00 0.99 2.96 -0.81 -2.21 118.68 123.04 2tss s LEU 143 Ca 0.00 2.90 0.00 0.00 -0.22 0.00 0.00 54.13 56.81 2tss s LEU 143 Cb 0.00 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 43.08 2tss s LEU 143 CO 0.00 -0.96 0.00 -1.22 -1.32 0.00 0.00 176.35 172.85 2tss n TYR 144 N 3.43 0.00 0.21 5.38 4.01 0.48 -4.49 117.16 126.18 2tss n TYR 144 Ca 0.14 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.99 2tss n TYR 144 Cb 0.36 -0.64 0.07 0.00 -0.31 0.00 0.00 39.34 38.82 2tss n TYR 144 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2tss h ARG 145 N 1.59 0.00 -3.71 -0.72 3.08 -1.64 -3.46 114.38 109.53 2tss h ARG 145 Ca 0.00 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.97 2tss h ARG 145 Cb 0.06 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 29.98 2tss h ARG 145 CO 0.00 0.00 -0.25 -1.54 -1.07 0.00 0.00 179.97 177.11 2tss s SER 146 N -5.41 -0.01 0.29 7.04 1.04 -1.26 -5.02 113.70 110.36 2tss s SER 146 Ca 0.03 -0.66 0.21 0.00 0.48 0.00 0.00 55.95 56.01 2tss s SER 146 Cb 0.09 0.43 1.07 0.00 0.10 0.00 0.00 66.02 67.70 2tss s SER 146 CO 0.75 -0.85 1.64 -1.54 0.98 0.00 0.00 173.24 174.22 2tss n SER 147 N -0.18 0.56 -0.76 7.02 3.41 -1.26 -1.99 113.62 120.42 2tss n SER 147 Ca -0.12 0.72 0.11 0.00 -0.26 0.00 0.00 58.87 59.33 2tss n SER 147 Cb 0.63 -0.81 0.31 0.00 -0.26 0.00 0.00 64.21 64.08 2tss n SER 147 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2tss n ASP 148 N -2.21 2.28 -3.36 4.04 5.75 -1.26 -4.48 116.55 117.31 2tss n ASP 148 Ca -0.00 -1.81 -0.26 0.00 -0.01 0.00 0.00 54.79 52.71 2tss n ASP 148 Cb 0.08 -0.14 -0.09 0.00 -1.03 0.00 0.00 41.12 39.94 2tss n ASP 148 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2tss n LYS 149 N 0.73 0.45 0.00 0.11 5.02 -0.84 -4.80 118.16 118.83 2tss n LYS 149 Ca 0.17 -3.28 0.00 0.00 -2.02 0.00 0.00 58.31 53.18 2tss n LYS 149 Cb 0.43 -1.59 0.00 0.00 -0.02 0.00 0.00 35.03 33.85 2tss n LYS 149 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2tss n THR 150 N 2.38 0.27 -3.85 -0.18 -2.24 -1.22 -0.38 114.28 109.05 2tss n THR 150 Ca 0.27 -0.37 -0.09 0.00 -2.27 0.00 0.00 64.05 61.58 2tss n THR 150 Cb 0.49 1.10 0.01 0.00 -2.10 0.00 0.00 70.33 69.83 2tss n THR 150 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2tss s GLY 151 N -0.27 0.48 0.00 3.38 0.00 -1.20 -4.09 107.32 105.62 2tss s GLY 151 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 44.72 43.90 2tss s GLY 151 CO 0.00 -0.38 0.00 0.61 0.00 0.00 0.00 173.10 173.33 2tss n GLY 152 N -0.53 0.60 3.72 0.20 0.00 -1.26 0.51 105.19 108.43 2tss n GLY 152 Ca -0.07 -1.70 -0.05 0.00 0.00 0.00 0.00 46.02 44.20 2tss n GLY 152 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2tss s TYR 153 N -2.93 -0.18 0.12 1.61 -0.85 -0.88 -0.99 117.35 113.24 2tss s TYR 153 Ca 0.00 -0.11 0.08 0.00 -0.52 0.00 0.00 57.07 56.52 2tss s TYR 153 Cb 0.00 0.63 -0.04 0.00 0.38 0.00 0.00 41.96 42.93 2tss s TYR 153 CO 0.00 -0.83 -0.19 1.67 -1.52 0.00 0.00 175.55 174.68 2tss s TRP 154 N -3.33 1.75 -0.09 -3.49 1.48 -0.90 -1.38 118.94 112.98 2tss s TRP 154 Ca 0.11 -0.44 -0.04 0.00 -1.06 0.00 0.00 56.10 54.66 2tss s TRP 154 Cb -0.02 -0.93 0.04 0.00 -1.16 0.00 0.00 33.47 31.41 2tss s TRP 154 CO 0.01 0.23 0.20 0.21 -4.06 0.00 0.00 176.95 173.54 2tss s LYS 155 N -2.22 0.15 -0.17 3.25 2.20 0.12 -2.07 119.74 121.00 2tss s LYS 155 Ca 0.09 0.48 -0.06 0.00 -0.36 0.00 0.00 55.97 56.12 2tss s LYS 155 Cb -0.08 -0.15 -0.03 0.00 -1.51 0.00 0.00 37.83 36.05 2tss s LYS 155 CO 0.05 -0.18 0.01 0.42 -0.36 0.00 0.00 175.35 175.29 2tss s ILE 156 N 1.34 4.32 -0.15 5.43 1.01 0.59 -0.84 121.20 132.90 2tss s ILE 156 Ca -0.08 -0.20 -0.00 0.00 0.00 0.00 0.00 60.65 60.36 2tss s ILE 156 Cb -0.11 -2.93 -0.01 0.00 0.01 0.00 0.00 42.46 39.42 2tss s ILE 156 CO -0.07 0.47 -0.13 -0.89 0.00 0.00 0.00 174.94 174.31 2tss s THR 157 N 0.44 2.90 0.56 2.92 2.01 -0.23 -1.44 115.64 122.81 2tss s THR 157 Ca -0.00 -0.70 -0.03 0.00 0.31 0.00 0.00 61.69 61.27 2tss s THR 157 Cb -0.13 -2.23 0.02 0.00 0.01 0.00 0.00 72.50 70.16 2tss s THR 157 CO 0.02 0.51 0.83 -0.04 -0.69 0.00 0.00 174.62 175.25 2tss s MET 158 N 0.66 2.78 0.46 4.92 1.00 0.01 0.14 119.30 129.27 2tss s MET 158 Ca -0.07 -0.32 0.17 0.00 0.00 0.00 0.00 55.69 55.47 2tss s MET 158 Cb -0.16 -2.38 1.13 0.00 0.00 0.00 0.00 34.83 33.43 2tss s MET 158 CO 0.02 -0.66 2.00 -0.91 0.00 0.00 0.00 175.02 175.47 2tss h ASN 159 N -0.03 0.25 -0.01 3.03 2.35 -1.32 -0.34 115.58 119.51 2tss h ASN 159 Ca -0.45 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.31 2tss h ASN 159 Cb 1.27 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 39.59 2tss h ASN 159 CO 0.58 0.15 0.00 -0.90 -1.65 0.00 0.00 177.43 175.61 2tss n ASP 160 N -4.46 0.47 0.00 5.81 5.68 -1.26 -4.90 116.55 117.90 2tss n ASP 160 Ca 0.09 -1.22 0.00 0.00 -0.50 0.00 0.00 54.79 53.15 2tss n ASP 160 Cb 0.40 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.37 2tss n ASP 160 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2tss n GLY 161 N 1.02 0.84 3.79 6.12 0.00 -0.14 -5.06 105.19 111.77 2tss n GLY 161 Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 2tss n GLY 161 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2tss s SER 162 N -2.71 5.93 0.22 1.61 1.04 -1.26 -4.74 113.70 113.79 2tss s SER 162 Ca 0.00 1.94 0.05 0.00 0.48 0.00 0.00 55.95 58.42 2tss s SER 162 Cb 0.00 -2.55 -0.05 0.00 0.10 0.00 0.00 66.02 63.52 2tss s SER 162 CO 0.00 -1.06 -0.05 0.42 0.98 0.00 0.00 173.24 173.53 2tss s THR 163 N -2.13 1.23 -0.00 2.02 -4.23 -1.26 -0.81 115.64 110.46 2tss s THR 163 Ca 0.67 -2.07 0.00 0.00 -1.18 0.00 0.00 61.69 59.11 2tss s THR 163 Cb -0.18 -2.23 0.00 0.00 1.34 0.00 0.00 72.50 71.43 2tss s THR 163 CO 0.29 -0.44 -0.00 -0.31 -0.54 0.00 0.00 174.62 173.62 2tss s TYR 164 N -3.29 0.05 0.10 3.99 2.02 -0.52 -5.00 117.35 114.70 2tss s TYR 164 Ca 0.26 0.00 -0.11 0.00 -0.37 0.00 0.00 57.07 56.85 2tss s TYR 164 Cb 0.04 -0.06 0.01 0.00 -0.40 0.00 0.00 41.96 41.55 2tss s TYR 164 CO 0.07 -0.01 0.25 1.14 -1.57 0.00 0.00 175.55 175.43 2tss s GLN 165 N 0.12 0.90 -0.02 -0.62 -2.07 -1.26 -0.30 119.66 116.41 2tss s GLN 165 Ca -0.01 -0.86 -0.03 0.00 -1.82 0.00 0.00 55.36 52.64 2tss s GLN 165 Cb -0.02 0.38 0.00 0.00 -1.09 0.00 0.00 33.01 32.28 2tss s GLN 165 CO -0.00 -0.31 0.07 0.45 -1.32 0.00 0.00 175.29 174.18 2tss s SER 166 N -2.80 -0.05 -0.15 12.60 0.15 -0.88 -4.99 113.70 117.58 2tss s SER 166 Ca 0.04 0.08 -0.27 0.00 0.70 0.00 0.00 55.95 56.50 2tss s SER 166 Cb 0.04 0.16 -0.01 0.00 -1.71 0.00 0.00 66.02 64.49 2tss s SER 166 CO -0.11 -0.07 0.90 -0.62 1.20 0.00 0.00 173.24 174.54 2tss s ASP 167 N -0.17 7.07 0.34 5.45 -1.08 -1.26 -2.11 116.67 124.90 2tss s ASP 167 Ca -0.02 1.31 0.26 0.00 -0.52 0.00 0.00 52.55 53.58 2tss s ASP 167 Cb -0.02 -2.49 1.07 0.00 -1.46 0.00 0.00 42.92 40.01 2tss s ASP 167 CO 0.00 -0.42 1.79 -0.07 0.52 0.00 0.00 175.17 176.98 2tss h LEU 168 N 8.23 0.00 -0.27 -1.34 3.38 -1.41 -2.97 115.31 120.92 2tss h LEU 168 Ca -0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.67 2tss h LEU 168 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 2tss h LEU 168 CO 0.85 0.00 -0.04 -1.54 0.09 0.00 0.00 178.44 177.80 2tss n SER 169 N -2.48 0.46 -4.22 -0.43 3.41 -1.26 -4.72 113.62 104.38 2tss n SER 169 Ca 0.02 -0.88 -0.13 0.00 -0.26 0.00 0.00 58.87 57.62 2tss n SER 169 Cb 0.27 -0.05 -0.10 0.00 -0.26 0.00 0.00 64.21 64.07 2tss n SER 169 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2tss s LYS 170 N -2.21 0.99 0.54 4.33 1.02 -1.12 -4.92 119.74 118.36 2tss s LYS 170 Ca 0.38 -1.42 -0.19 0.00 0.02 0.00 0.00 55.97 54.76 2tss s LYS 170 Cb 0.21 -0.46 -0.06 0.00 -0.52 0.00 0.00 37.83 37.00 2tss s LYS 170 CO 0.41 0.03 1.10 0.21 -0.92 0.00 0.00 175.35 176.17 2tss s LYS 171 N -3.79 3.41 0.32 1.68 2.20 -1.26 -4.82 119.74 117.49 2tss s LYS 171 Ca 0.15 1.48 -0.27 0.00 -0.36 0.00 0.00 55.97 56.97 2tss s LYS 171 Cb 0.04 -2.03 -0.13 0.00 -1.51 0.00 0.00 37.83 34.20 2tss s LYS 171 CO -0.01 -0.77 1.06 0.34 -0.36 0.00 0.00 175.35 175.60 2tss n PHE 172 N -1.40 1.43 -2.69 4.03 7.35 -1.26 -4.86 117.46 120.05 2tss n PHE 172 Ca 0.11 0.65 -0.43 0.00 -0.76 0.00 0.00 57.45 57.02 2tss n PHE 172 Cb 0.52 -2.27 -0.02 0.00 0.35 0.00 0.00 39.48 38.06 2tss n PHE 172 CO 0.00 0.00 0.00 -2.00 -0.76 0.00 0.00 176.76 174.00 2tss s GLU 173 N -1.69 3.78 0.33 -4.13 2.12 -1.26 -4.84 118.70 113.01 2tss s GLU 173 Ca 0.59 -1.70 0.03 0.00 0.36 0.00 0.00 54.97 54.24 2tss s GLU 173 Cb -0.65 -5.29 0.57 0.00 0.26 0.00 0.00 34.13 29.02 2tss s GLU 173 CO 0.60 -2.08 1.88 1.88 -0.54 0.00 0.00 175.26 177.00 2tss h TYR 174 N 8.60 0.63 0.00 5.30 0.05 -1.99 -2.88 116.97 126.68 2tss h TYR 174 Ca 0.28 -0.05 0.00 0.00 0.05 0.00 0.00 58.73 59.01 2tss h TYR 174 Cb 0.95 -0.19 0.00 0.00 1.01 0.00 0.00 36.73 38.51 2tss h TYR 174 CO 1.28 0.56 0.00 0.27 -1.05 0.00 0.00 178.16 179.22 2tss n ASN 175 N -4.30 0.00 -0.07 3.88 0.23 -1.26 -2.46 115.26 111.27 2tss n ASN 175 Ca 0.02 0.47 0.04 0.00 -0.53 0.00 0.00 54.58 54.58 2tss n ASN 175 Cb 0.22 -0.49 0.05 0.00 -2.08 0.00 0.00 39.78 37.48 2tss n ASN 175 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 2tss n THR 176 N -1.49 1.13 -1.68 5.53 -2.24 -1.10 -4.17 114.28 110.26 2tss n THR 176 Ca 0.04 -1.27 -0.45 0.00 -2.27 0.00 0.00 64.05 60.10 2tss n THR 176 Cb 0.16 0.28 -0.03 0.00 -2.10 0.00 0.00 70.33 68.65 2tss n THR 176 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2tss n GLU 177 N -0.75 2.14 -2.37 -0.78 2.13 -1.03 -4.91 120.64 115.07 2tss n GLU 177 Ca 0.06 0.76 -0.25 0.00 0.66 0.00 0.00 57.16 58.40 2tss n GLU 177 Cb 0.46 -2.46 0.05 0.00 0.27 0.00 0.00 31.44 29.76 2tss n GLU 177 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2tss s LYS 178 N -0.09 2.41 0.73 5.31 -0.14 -1.26 -3.51 119.74 123.20 2tss s LYS 178 Ca 0.70 -0.36 -0.15 0.00 -1.36 0.00 0.00 55.97 54.79 2tss s LYS 178 Cb -0.64 -2.28 0.04 0.00 -1.68 0.00 0.00 37.83 33.27 2tss s LYS 178 CO 0.46 -1.00 1.22 -2.30 -0.76 0.00 0.00 175.35 172.98 2tss n PRO 179 N -2.70 0.60 -1.13 -1.68 -0.02 -1.24 -4.62 135.00 124.21 2tss n PRO 179 Ca 0.07 0.27 -0.34 0.00 -2.02 0.00 0.00 63.50 61.48 2tss n PRO 179 Cb 0.60 -2.46 0.10 0.00 -0.02 0.00 0.00 33.50 31.72 2tss n PRO 179 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2tss n PRO 180 N -2.59 0.18 -4.45 0.52 -0.02 -1.26 -4.69 135.00 122.69 2tss n PRO 180 Ca 0.15 0.12 -0.24 0.00 -2.02 0.00 0.00 63.50 61.50 2tss n PRO 180 Cb 0.49 -2.14 -0.10 0.00 -0.02 0.00 0.00 33.50 31.73 2tss n PRO 180 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 2tss s ILE 181 N -2.07 2.57 -0.30 4.25 -4.36 -0.78 -4.91 121.20 115.60 2tss s ILE 181 Ca 0.68 -2.23 -0.26 0.00 -0.26 0.00 0.00 60.65 58.59 2tss s ILE 181 Cb -0.30 -2.53 0.01 0.00 1.25 0.00 0.00 42.46 40.88 2tss s ILE 181 CO 0.55 -0.32 0.90 0.20 0.24 0.00 0.00 174.94 176.52 2tss s ASN 182 N -3.59 6.79 0.49 4.36 0.01 -1.26 -2.04 114.94 119.71 2tss s ASN 182 Ca 0.32 0.86 0.27 0.00 -0.71 0.00 0.00 52.86 53.60 2tss s ASN 182 Cb -0.03 -2.46 1.24 0.00 0.41 0.00 0.00 41.25 40.41 2tss s ASN 182 CO 0.17 -0.70 1.96 0.16 -1.51 0.00 0.00 177.10 177.18 2tss h ILE 183 N 5.62 0.47 0.00 0.60 3.07 -1.58 -2.29 117.51 123.41 2tss h ILE 183 Ca -0.23 -0.78 0.00 0.00 1.55 0.00 0.00 64.86 65.41 2tss h ILE 183 Cb 1.08 1.54 0.00 0.00 -0.27 0.00 0.00 36.82 39.17 2tss h ILE 183 CO 0.94 0.15 0.00 -0.90 -1.05 0.00 0.00 178.15 177.29 2tss n ASP 184 N -3.44 0.00 -0.87 2.16 5.75 -1.26 -2.45 116.55 116.43 2tss n ASP 184 Ca -0.01 -0.70 0.09 0.00 -0.01 0.00 0.00 54.79 54.17 2tss n ASP 184 Cb 0.33 -0.03 0.14 0.00 -1.03 0.00 0.00 41.12 40.53 2tss n ASP 184 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2tss n GLU 185 N -1.03 2.05 -2.74 0.11 1.02 -0.86 -4.95 120.64 114.23 2tss n GLU 185 Ca 0.18 -1.92 -0.42 0.00 -0.02 0.00 0.00 57.16 54.98 2tss n GLU 185 Cb 0.10 -1.40 -0.03 0.00 -0.02 0.00 0.00 31.44 30.09 2tss n GLU 185 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2tss s ILE 186 N -1.36 4.86 -0.18 -3.67 1.01 -1.03 -0.87 121.20 119.97 2tss s ILE 186 Ca 0.28 1.99 -0.17 0.00 0.00 0.00 0.00 60.65 62.75 2tss s ILE 186 Cb 0.17 -4.29 -0.13 0.00 0.01 0.00 0.00 42.46 38.23 2tss s ILE 186 CO 0.25 0.12 0.10 0.50 0.00 0.00 0.00 174.94 175.91 2tss h LYS 187 N 6.89 0.00 -3.71 2.79 3.64 -0.54 -3.45 116.57 122.20 2tss h LYS 187 Ca -0.38 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 58.89 2tss h LYS 187 Cb 1.20 0.00 -0.17 0.00 -0.41 0.00 0.00 32.23 32.85 2tss h LYS 187 CO 0.78 0.61 -0.44 0.95 -2.27 0.00 0.00 179.45 179.08 2tss s THR 188 N -2.28 0.13 -0.08 1.00 -4.23 -0.95 -4.84 115.64 104.39 2tss s THR 188 Ca -0.22 -1.04 0.01 0.00 -1.18 0.00 0.00 61.69 59.25 2tss s THR 188 Cb 0.04 -1.00 0.02 0.00 1.34 0.00 0.00 72.50 72.90 2tss s THR 188 CO 0.44 -0.58 -0.09 -0.63 -0.54 0.00 0.00 174.62 173.23 2tss s ILE 189 N -2.85 0.97 -0.00 2.99 1.01 -0.56 -1.07 121.20 121.69 2tss s ILE 189 Ca -0.03 -0.32 0.04 0.00 0.00 0.00 0.00 60.65 60.34 2tss s ILE 189 Cb 0.00 -0.95 -0.01 0.00 0.01 0.00 0.00 42.46 41.51 2tss s ILE 189 CO -0.06 0.34 -0.12 -1.83 0.00 0.00 0.00 174.94 173.27 2tss s GLU 190 N 1.20 0.96 -0.03 2.79 -1.05 -0.02 -1.22 118.70 121.33 2tss s GLU 190 Ca -0.05 -0.48 0.01 0.00 -0.15 0.00 0.00 54.97 54.30 2tss s GLU 190 Cb -0.14 -0.93 0.02 0.00 -0.44 0.00 0.00 34.13 32.63 2tss s GLU 190 CO -0.02 0.25 -0.03 0.00 0.95 0.00 0.00 175.26 176.40 2tss s ALA 191 N -0.38 0.52 -0.07 -0.84 0.00 -0.35 0.16 121.76 120.80 2tss s ALA 191 Ca 0.04 -0.03 0.03 0.00 0.00 0.00 0.00 51.96 52.00 2tss s ALA 191 Cb -0.05 -0.31 0.01 0.00 0.00 0.00 0.00 23.12 22.76 2tss s ALA 191 CO -0.00 0.01 -0.15 -1.21 0.00 0.00 0.00 175.76 174.41 2tss s GLU 192 N 0.68 1.93 -0.17 0.00 2.02 -0.48 -1.18 118.70 121.51 2tss s GLU 192 Ca -0.08 -0.51 -0.07 0.00 0.02 0.00 0.00 54.97 54.33 2tss s GLU 192 Cb -0.11 -1.57 -0.04 0.00 0.10 0.00 0.00 34.13 32.51 2tss s GLU 192 CO -0.00 0.07 0.07 0.42 0.02 0.00 0.00 175.26 175.84 2tss s ILE 193 N 0.55 4.90 -2.69 -1.63 1.01 0.07 -2.07 121.20 121.33 2tss s ILE 193 Ca -0.14 0.00 0.22 0.00 0.00 0.00 0.00 60.65 60.72 2tss s ILE 193 Cb -0.16 -3.19 0.17 0.00 0.01 0.00 0.00 42.46 39.29 2tss s ILE 193 CO 0.05 0.49 1.18 0.59 0.00 0.00 0.00 174.94 177.24